Vitas-M small molecule compound
2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 3-chlorobenzoate
Catalog ID
STK381085
SMILES Clc1cccc(c1)C(=O)OCC(=O)c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H13Cl2NO6 MW 446.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2NO6/c22-15-4-1-3-14(11-15)21(26)29-12-19(25)13-7-9-16(10-8-13)30-20-17(23)5-2-6-18(20)24(27)28/h1-11H,12H2InChIKey
KVEBUCSQJBAOQT-UHFFFAOYSA-NSynonyms
(2(4(2CHLORO6NITROPHENOXY)PHENYL)2OXOETHYL)3CHLOROBENZOATE
2(4(2chloro6nitrophenoxy)phenyl)2oxoethyl3chlorobenzoate
2(4(6CHLORO2NITROPHENOXY)PHENYL)2OXOETHYL3CHLOROBENZOATE
C1=CC(=CC(=C1)Cl)C(=O)OCC(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3Cl)(N+)(=O)(O)
Clc1cccc(c1)C(=O)OCC(=O)c1ccc(cc1)Oc1c(Cl)cccc1(N+)(=O)(O)
InChI=1SC21H13Cl2NO6c221541314(1115)21(26)291219(25)137916(10813)302017(23)52618(20)24(27)28h111H12H2
MFCD02762318
ZINC000001174031
ZINC01174031
ZINC1174031
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